## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
B |
73 |
18 |
10593 |
◊ |
A |
x,y,z |
1_555 |
85 |
25 |
10484 |
666.5 |
-3.4 |
0.486 |
3 |
0 |
0 |
0.000 |
2 |
|
D |
65 |
18 |
10461 |
◊ |
C |
x,y,z |
1_555 |
86 |
25 |
10549 |
662.9 |
-1.1 |
0.610 |
5 |
0 |
0 |
0.000 |
Average: |
664.7 |
-2.3 |
0.548 |
4 |
0 |
0 |
0.000 |
2 |
3 |
|
C |
69 |
25 |
10549 |
◊ |
B |
x,y,z |
1_555 |
69 |
25 |
10593 |
651.3 |
-6.0 |
0.265 |
6 |
0 |
0 |
0.000 |
4 |
|
D |
72 |
26 |
10461 |
◊ |
A |
x,y,z |
1_555 |
74 |
26 |
10484 |
633.0 |
-6.0 |
0.279 |
4 |
0 |
0 |
0.000 |
Average: |
642.2 |
-6.0 |
0.272 |
5 |
0 |
0 |
0.000 |
3 |
5 |
|
C |
68 |
23 |
10549 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
69 |
19 |
10593 |
588.9 |
-2.3 |
0.529 |
10 |
3 |
0 |
0.000 |
6 |
|
D |
71 |
18 |
10461 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
62 |
23 |
10484 |
588.2 |
-0.9 |
0.661 |
10 |
2 |
0 |
0.000 |
Average: |
588.6 |
-1.6 |
0.595 |
10 |
3 |
0 |
0.000 |
4 |
7 |
|
[9F2]B:301 |
31 |
1 |
742 |
f |
B |
x,y,z |
1_555 |
58 |
23 |
10593 |
302.1 |
0.5 |
0.504 |
11 |
0 |
0 |
0.028 |
8 |
|
[9F2]D:301 |
32 |
1 |
738 |
f |
D |
x,y,z |
1_555 |
59 |
24 |
10461 |
283.6 |
-0.1 |
0.469 |
11 |
0 |
0 |
0.028 |
Average: |
292.9 |
0.2 |
0.486 |
11 |
0 |
0 |
0.028 |
5 |
9 |
|
D |
29 |
8 |
10461 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
28 |
7 |
10593 |
236.7 |
-3.2 |
0.275 |
2 |
0 |
0 |
0.000 |
6 |
10 |
|
[FZS]D:302 |
26 |
1 |
581 |
cf |
D |
x,y,z |
1_555 |
51 |
21 |
10461 |
233.8 |
-2.2 |
0.613 |
11 |
0 |
0 |
0.040 |
11 |
|
[FZS]B:302 |
26 |
1 |
576 |
cf |
B |
x,y,z |
1_555 |
50 |
20 |
10593 |
221.1 |
-2.1 |
0.610 |
12 |
0 |
0 |
0.040 |
Average: |
227.5 |
-2.2 |
0.612 |
12 |
0 |
0 |
0.040 |
7 |
12 |
|
[FZS]D:302 |
24 |
1 |
581 |
f |
[9F2]D:301 |
x,y,z |
1_555 |
28 |
1 |
738 |
200.6 |
-2.3 |
0.408 |
0 |
0 |
0 |
0.016 |
13 |
|
[FZS]B:302 |
26 |
1 |
576 |
f |
[9F2]B:301 |
x,y,z |
1_555 |
28 |
1 |
742 |
198.5 |
-2.9 |
0.365 |
0 |
0 |
0 |
0.016 |
Average: |
199.5 |
-2.6 |
0.386 |
0 |
0 |
0 |
0.016 |
8 |
14 |
|
[9F2]C:302 |
18 |
1 |
759 |
f |
D |
x,y,z |
1_555 |
26 |
11 |
10461 |
185.8 |
-2.8 |
0.222 |
2 |
0 |
0 |
0.021 |
15 |
|
[9F2]A:302 |
20 |
1 |
748 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
10593 |
185.4 |
-3.1 |
0.199 |
2 |
0 |
0 |
0.021 |
Average: |
185.6 |
-2.9 |
0.210 |
2 |
0 |
0 |
0.021 |
9 |
16 |
|
[9F2]A:302 |
20 |
1 |
748 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
10484 |
165.5 |
1.3 |
0.622 |
3 |
0 |
0 |
0.000 |
17 |
|
[9F2]C:302 |
19 |
1 |
759 |
◊ |
C |
x,y,z |
1_555 |
22 |
8 |
10549 |
157.9 |
1.2 |
0.607 |
3 |
0 |
0 |
0.000 |
Average: |
161.7 |
1.3 |
0.614 |
3 |
0 |
0 |
0.000 |
10 |
18 |
|
[9F2]B:301 |
23 |
1 |
742 |
f |
[9F2]A:302 |
x,y,z |
1_555 |
25 |
1 |
748 |
161.9 |
0.5 |
0.372 |
0 |
0 |
0 |
0.000 |
19 |
|
[9F2]D:301 |
18 |
1 |
738 |
f |
[9F2]C:302 |
x,y,z |
1_555 |
26 |
1 |
759 |
148.2 |
0.3 |
0.334 |
0 |
0 |
0 |
0.000 |
Average: |
155.1 |
0.4 |
0.353 |
0 |
0 |
0 |
0.000 |
11 |
20 |
|
[FZS]D:302 |
13 |
1 |
581 |
f |
[9F2]C:302 |
x,y,z |
1_555 |
16 |
1 |
759 |
114.8 |
-0.2 |
0.544 |
0 |
0 |
0 |
0.003 |
21 |
|
[FZS]B:302 |
14 |
1 |
576 |
f |
[9F2]A:302 |
x,y,z |
1_555 |
18 |
1 |
748 |
106.2 |
-0.6 |
0.525 |
0 |
0 |
0 |
0.003 |
Average: |
110.5 |
-0.4 |
0.534 |
0 |
0 |
0 |
0.003 |
12 |
22 |
|
[PO4]C:301 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
18 |
8 |
10549 |
109.1 |
-7.6 |
0.613 |
6 |
0 |
0 |
0.100 |
13 |
23 |
|
[PO4]A:301 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
10484 |
102.8 |
-7.2 |
0.620 |
5 |
0 |
0 |
0.100 |
14 |
24 |
|
D |
8 |
4 |
10461 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
9 |
5 |
10484 |
80.6 |
-0.5 |
0.350 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
[PO4]A:301 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
10593 |
43.5 |
-1.8 |
0.907 |
1 |
0 |
0 |
0.000 |
16 |
26 |
|
[PO4]C:301 |
3 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
10461 |
37.2 |
-1.4 |
0.861 |
1 |
0 |
0 |
0.000 |
17 |
27 |
|
[9F2]B:301 |
3 |
1 |
742 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10484 |
22.6 |
0.2 |
0.519 |
0 |
0 |
0 |
0.000 |
28 |
|
[9F2]D:301 |
2 |
1 |
738 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
10549 |
18.1 |
0.1 |
0.481 |
0 |
0 |
0 |
0.000 |
Average: |
20.4 |
0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
18 |
29 |
|
[FZS]D:302 |
3 |
1 |
581 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
10549 |
19.2 |
0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
30 |
|
[FZS]B:302 |
1 |
1 |
576 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10484 |
19.0 |
0.2 |
0.468 |
0 |
0 |
0 |
0.000 |
Average: |
19.1 |
0.1 |
0.573 |
0 |
0 |
0 |
0.000 |
|